prop-2-enyl 6,7-bis(chloranyl)-3-methyl-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-carboxylate

Systemtic Name: prop-2-enyl 6,7-bis(chloranyl)-3-methyl-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-carboxylate Openeye Name: allyl 6,7-dichloro-3-methyl-4-oxido-1-oxo-quinoxalin-1-ium-2-carboxylate CAS Name: 6,7-dichloro-3-methyl-4-oxido-1-oxo-2-quinoxalin-1-iumcarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 6,7-dichloro-3-methyl-4-oxido-1-oxoquinoxalin-1-ium-2-carboxylate Traditional Name: 6,7-dichloro-1-keto-3-methyl-4-oxido-quinoxalin-1-ium-2-carboxylic acid allyl ester Formula: C13H10Cl2N2O4 MolecularWeight: 329.1355

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C([N+](=O)C2=CC(=C(C=C2N1[O-])Cl)Cl)C(=O)OCC=C

Isomeric SMILES

CC1=C([N+](=O)C2=CC(=C(C=C2N1[O-])Cl)Cl)C(=O)OCC=C

InChI

InChI=1S/C13H10Cl2N2O4/c1-3-4-21-13(18)12-7(2)16(19)10-5-8(14)9(15)6-11(10)17(12)20/h3,5-6H,1,4H2,2H3